1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine

C15H26N4O — CID 104515849

IUPAC1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCOc1nccnc1C(N)C1(N(C)C)CCC(C)CC1
InChIInChI=1S/C15H26N4O/c1-11-5-7-15(8-6-11,19(2)3)13(16)12-14(20-4)18-10-9-17-12/h9-11,13H,5-8,16H2,1-4H3
InChIKeyFARGMLVGJGAJST-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.00
Rot. Bonds4

About 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine

1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine (PubChem CID 104515849) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
PubChem CID104515849
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCOc1nccnc1C(N)C1(N(C)C)CCC(C)CC1
InChIInChI=1S/C15H26N4O/c1-11-5-7-15(8-6-11,19(2)3)13(16)12-14(20-4)18-10-9-17-12/h9-11,13H,5-8,16H2,1-4H3
InChIKeyFARGMLVGJGAJST-UHFFFAOYSA-N
XLogP2.00
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1-ethoxy-3-methylcyclohexyl)-(3-methoxypyrazin-2-yl)methanamine
CID 116768146
1-[(3-methoxypyrazin-2-yl)-(methylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 104515854
[(3-methoxypyrazin-2-yl)-(3-methylcyclopentyl)methyl]hydrazine
CID 105233232
2-cycloheptyl-1-(3-methoxypyrazin-2-yl)ethanamine
CID 105032196
1-[amino-(2-ethoxyphenyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79061084
1-[amino-(3,4-dichlorophenyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79074952
(4,4-difluorocyclohexyl)-(3-methoxypyrazin-2-yl)methanol
CID 105123934
1-(4,4-dimethylcyclohexyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515704
2-methoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 104515873
(3-methoxypyrazin-2-yl)-(3-tricyclo[3.2.1.02,4]octanyl)methanamine
CID 114097391
1-(1-amino-2-pyridin-2-ylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 79074427
1-[amino(cyclohepten-1-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 106653714

Frequently Asked Questions

What is the IUPAC name of 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The IUPAC name of 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine (CID 104515849) is 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine is COc1nccnc1C(N)C1(N(C)C)CCC(C)CC1.
What is the InChIKey of 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The InChIKey is FARGMLVGJGAJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11-5-7-15(8-6-11,19(2)3)13(16)12-14(20-4)18-10-9-17-12/h9-11,13H,5-8,16H2,1-4H3.
What are the key properties of 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[amino-(3-methoxypyrazin-2-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine is sourced from PubChem (CID 104515849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).